SCHEMBL12822982

SCHEMBL12822982

C=CCCOc1ccc(C2CCC(COc3ccc(-c4ccc(C(C)O)cc4)c(F)c3F)CC2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 5/20 0.36
▸ ACACB O00763 6/20 0.34
▸ APP P05067 1/20 0.33
▸ DUT P33316 2/20 0.30
▸ FPR2 P25090 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12821795 0.92 APP (0.34) FFAR4ACACBAPPFPR2
SCHEMBL12716695 0.90 ACACB (0.34) FFAR4ACACB
SCHEMBL12716248 0.89 APP (0.34) APPFPR2
SCHEMBL12736145 0.89 FFAR4 (0.36) FFAR4FPR2
SCHEMBL13586449 0.89 KDM1A (0.39) FFAR4ACACBAPPFPR2
SCHEMBL12823351 0.88 ALOX5AP (0.34) FFAR4ACACB
SCHEMBL12823832 0.88 ALOX5AP (0.34) FFAR4ACACB
SCHEMBL12821144 0.88 APP (0.32) APP
SCHEMBL14765785 0.87 FFAR4 (0.35) FFAR4ACACBFPR2
SCHEMBL12717197 0.87 FFAR4 (0.36) FFAR4ACACB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 — — US disclosed
WO-2009150966-A1 TETRACYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 FFAR4 546/4885ACACB 3260/4885APP 2200/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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